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5-[(E)-alpha-Chlorobenzyliden]-6,6-diethylbicyclo[2.2.1]hept-2-ene
SpectraBase Compound ID 4A6x5SjDiK4
InChI InChI=1S/C18H21Cl/c1-3-18(4-2)15-11-10-14(12-15)16(18)17(19)13-8-6-5-7-9-13/h5-11,14-15H,3-4,12H2,1-2H3/b17-16+/t14-,15+/m0/s1
InChIKey PJVMZGDAZHLJNS-LKGOISKRSA-N
Mol Weight 272.82 g/mol
Molecular Formula C18H21Cl
Exact Mass 272.133178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21vszCy85p1
Name 5-[(E)-alpha-Chlorobenzyliden]-6,6-diethylbicyclo[2.2.1]hept-2-ene
Alternate Name(s) (1S,4R,E)-6-(chloro(phenyl)methylene)-5,5-diethylbicyclo[2.2.1]hept-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21Cl
InChI InChI=1S/C18H21Cl/c1-3-18(4-2)15-11-10-14(12-15)16(18)17(19)13-8-6-5-7-9-13/h5-11,14-15H,3-4,12H2,1-2H3/b17-16+/t14-,15+/m0/s1
InChIKey PJVMZGDAZHLJNS-LKGOISKRSA-N
Molecular Weight 272.819 g/mol
SMILES C=1[C@]2(C[C@@](C1)(C(\C2=C\(c1ccccc1)Cl)(CC)CC)[H])[H]
SPLASH splash10-00di-0390000000-ed3037ddaa99f1b5fcb3
Source of Spectrum K-115-3508-15g
Wiley ID 1791895